N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide

C117H148N32O9 — CID 159136471

IUPACN-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide
SMILESCCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN)cc2)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2ccc3c(c2)CCNC3)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2ccc3c(c2)CNCC3)ncn1.COCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN)cc2)ncn1.COCCN(CC1CC1)c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1.COCCN(c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1)C(C)C
InChIInChI=1S/2C21H27N5O.C19H22N6O2.C19H25N5O2.C19H25N5O.C18H22N6O2/c1-2-9-26(13-15-3-4-15)20-11-19(23-14-24-20)21(27)25-18-6-5-17-12-22-8-7-16(17)10-18;1-2-9-26(13-15-3-4-15)20-11-19(23-14-24-20)21(27)25-18-6-5-16-7-8-22-12-17(16)10-18;1-27-7-6-25(11-13-2-3-13)18-9-17(20-12-21-18)19(26)23-15-4-5-16-14(8-15)10-22-24-16;1-26-9-8-24(12-15-2-3-15)18-10-17(21-13-22-18)19(25)23-16-6-4-14(11-20)5-7-16;1-2-9-24(12-15-3-4-15)18-10-17(21-13-22-18)19(25)23-16-7-5-14(11-20)6-8-16;1-12(2)24(6-7-26-3)17-9-16(19-11-20-17)18(25)22-14-4-5-15-13(8-14)10-21-23-15/h2*5-6,10-11,14-15,22H,2-4,7-9,12-13H2,1H3,(H,25,27);4-5,8-10,12-13H,2-3,6-7,11H2,1H3,(H,22,24)(H,23,26);4-7,10,13,15H,2-3,8-9,11-12,20H2,1H3,(H,23,25);5-8,10,13,15H,2-4,9,11-12,20H2,1H3,(H,23,25);4-5,8-12H,6-7H2,1-3H3,(H,21,23)(H,22,25)
InChIKeyKHOAEQITXNDQLJ-UHFFFAOYSA-N
MW2146.69 g/mol
LogP15.80
Rot. Bonds46

About N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide

N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide (PubChem CID 159136471) has the molecular formula C117H148N32O9 and a molecular weight of 2146.69 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide
PubChem CID159136471
Molecular FormulaC117H148N32O9
Molecular Weight2146.69 g/mol
Exact Mass2145.21
IUPAC NameN-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide
SMILESCCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN)cc2)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2ccc3c(c2)CCNC3)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2ccc3c(c2)CNCC3)ncn1.COCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN)cc2)ncn1.COCCN(CC1CC1)c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1.COCCN(c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1)C(C)C
InChIInChI=1S/2C21H27N5O.C19H22N6O2.C19H25N5O2.C19H25N5O.C18H22N6O2/c1-2-9-26(13-15-3-4-15)20-11-19(23-14-24-20)21(27)25-18-6-5-17-12-22-8-7-16(17)10-18;1-2-9-26(13-15-3-4-15)20-11-19(23-14-24-20)21(27)25-18-6-5-16-7-8-22-12-17(16)10-18;1-27-7-6-25(11-13-2-3-13)18-9-17(20-12-21-18)19(26)23-15-4-5-16-14(8-15)10-22-24-16;1-26-9-8-24(12-15-2-3-15)18-10-17(21-13-22-18)19(25)23-16-6-4-14(11-20)5-7-16;1-2-9-24(12-15-3-4-15)18-10-17(21-13-22-18)19(25)23-16-7-5-14(11-20)6-8-16;1-12(2)24(6-7-26-3)17-9-16(19-11-20-17)18(25)22-14-4-5-15-13(8-14)10-21-23-15/h2*5-6,10-11,14-15,22H,2-4,7-9,12-13H2,1H3,(H,25,27);4-5,8-10,12-13H,2-3,6-7,11H2,1H3,(H,22,24)(H,23,26);4-7,10,13,15H,2-3,8-9,11-12,20H2,1H3,(H,23,25);5-8,10,13,15H,2-4,9,11-12,20H2,1H3,(H,23,25);4-5,8-12H,6-7H2,1-3H3,(H,21,23)(H,22,25)
InChIKeyKHOAEQITXNDQLJ-UHFFFAOYSA-N
XLogP15.80
TPSA509.87 Ų
H-Bond Donors12
H-Bond Acceptors33
Rotatable Bonds46
Heavy Atoms158
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002146.69
LogP ≤ 515.80
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1033

Analyze N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide with MolForge

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Related Compounds

6-(4-((4-(1H-pyrazol-4-yl)phenyl)-amino)-pyrimidin-2-yl)-N-(3-morpholino-cyclohexyl)-1H-indole-2-carboxamide
CID 137381950
1-[4-[9-(2-aminopyrimidin-5-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]-N-(1-methylpiperidin-4-yl)piperidine-4-carboxamide;1-[4-(2,3-dioxo-9-quinolin-3-yl-4H-pyrazino[2,3-c]quinolin-1-yl)-2-(trifluoromethyl)phenyl]-N-(1-methylpiperidin-4-yl)piperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)-1-[4-[9-(1-methylpyrazol-4-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]piperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)-1-[4-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 161109221
1-[4-[9-(2-aminopyrimidin-5-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]-N-(1-methylpiperidin-4-yl)piperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)-1-[4-[9-(1-methylpyrazol-4-yl)-2-oxobenzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]piperidine-4-carboxamide;N-(1-methylpiperidin-4-yl)-1-[4-[2-oxo-9-(1H-pyrazol-4-yl)benzo[h][1,6]naphthyridin-1-yl]-2-(trifluoromethyl)phenyl]piperidine-4-carboxamide;1-[4-[1-(2-morpholin-4-ylacetyl)piperidin-4-yl]-3-(trifluoromethyl)phenyl]-9-quinolin-3-ylbenzo[h][1,6]naphthyridin-2-one
CID 162069468
(2-benzyl-4,5-dihydroimidazol-1-yl)-[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]methanone;N-(cyclopropylmethyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(1H-indol-5-yl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-[2-(1-methylpyrrolidin-2-yl)ethyl]-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;N-(4-morpholin-4-ylphenyl)-4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide;[4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]-pyrrolidin-1-ylmethanone;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-(2-pyridin-2-ylethyl)benzamide;4-[3-(1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridin-5-yl]-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 162129461
3-[6-[1-[7-[[1-[[4-(3,8-diazabicyclo[3.2.1]octan-3-yl)-8-fluoro-7-(5-methyl-1H-indazol-4-yl)pyrido[4,3-d]pyrimidin-2-yl]oxymethyl]cyclopropyl]methyl]-7-azaspiro[3.5]nonan-2-yl]piperidin-4-yl]-2-oxobenzo[cd]indol-1-yl]piperidine-2,6-dione
CID 170931700
2-methyl-N-[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]pyrazole-3-carboxamide;3-methyl-4-[4-(2-methylpyrazol-3-yl)-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-2-yl]morpholine
CID 168458963
N-[3-(2-methyl-4-pyridinyl)-1H-indazol-5-yl]-3-(morpholin-4-ylmethyl)-1-[2-oxo-2-[4-(4-pyrimidin-2-ylphenyl)piperazin-1-yl]ethyl]pyrrolidine-3-carboxamide
CID 57686233
N-[4-(6-benzyl-4-morpholin-4-yl-7-oxo-5H-pyrrolo[3,4-d]pyrimidin-2-yl)phenyl]acetamide;4-[2-(4-pyrazol-1-ylphenyl)-7-pyrimidin-2-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]morpholine
CID 67276507
N-cyclopropyl-4-[2-morpholin-4-yl-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-4-yl]benzamide;N,N-dimethyl-2-[2-morpholin-4-yl-8-(1H-pyrazol-5-yl)-1,7-naphthyridin-4-yl]benzamide
CID 118869617
(3-morpholin-4-ylpiperidin-1-yl)-[6-[4-[4-(1H-pyrazol-4-yl)anilino]pyrimidin-2-yl]-1H-indol-2-yl]methanone
CID 137382248
7-[4-(1H-indazol-5-ylamino)pyrimidin-2-yl]-5-[[2-[6-[4-(1H-indazol-5-ylamino)pyrimidin-2-yl]-2-(pyridazin-4-ylcarbamoyl)indol-1-yl]ethyl-methylamino]methyl]-N-pyridazin-4-ylquinoline-2-carboxamide
CID 137387381
N-ethyl-3-methyl-N-[2-[5-morpholin-4-yl-1-[6-[4-[4-(1H-pyrazol-4-yl)anilino]pyrimidin-2-yl]-1H-indole-2-carbonyl]piperidin-3-yl]ethyl]-6-[4-[4-(1H-pyrazol-4-yl)anilino]pyrimidin-2-yl]-1H-indole-2-carboxamide
CID 137387396

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide (CID 159136471) is N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide is CCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN)cc2)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2ccc3c(c2)CCNC3)ncn1.CCCN(CC1CC1)c1cc(C(=O)Nc2ccc3c(c2)CNCC3)ncn1.COCCN(CC1CC1)c1cc(C(=O)Nc2ccc(CN)cc2)ncn1.COCCN(CC1CC1)c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1.COCCN(c1cc(C(=O)Nc2ccc3[nH]ncc3c2)ncn1)C(C)C.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide?
The InChIKey is KHOAEQITXNDQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C21H27N5O.C19H22N6O2.C19H25N5O2.C19H25N5O.C18H22N6O2/c1-2-9-26(13-15-3-4-15)20-11-19(23-14-24-20)21(27)25-18-6-5-17-12-22-8-7-16(17)10-18;1-2-9-26(13-15-3-4-15)20-11-19(23-14-24-20)21(27)25-18-6-5-16-7-8-22-12-17(16)10-18;1-27-7-6-25(11-13-2-3-13)18-9-17(20-12-21-18)19(26)23-15-4-5-16-14(8-15)10-22-24-16;1-26-9-8-24(12-15-2-3-15)18-10-17(21-13-22-18)19(25)23-16-6-4-14(11-20)5-7-16;1-2-9-24(12-15-3-4-15)18-10-17(21-13-22-18)19(25)23-16-7-5-14(11-20)6-8-16;1-12(2)24(6-7-26-3)17-9-16(19-11-20-17)18(25)22-14-4-5-15-13(8-14)10-21-23-15/h2*5-6,10-11,14-15,22H,2-4,7-9,12-13H2,1H3,(H,25,27);4-5,8-10,12-13H,2-3,6-7,11H2,1H3,(H,22,24)(H,23,26);4-7,10,13,15H,2-3,8-9,11-12,20H2,1H3,(H,23,25);5-8,10,13,15H,2-4,9,11-12,20H2,1H3,(H,23,25);4-5,8-12H,6-7H2,1-3H3,(H,21,23)(H,22,25).
What are the key properties of N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide?
N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide has a molecular weight of 2146.69 g/mol, XLogP of 15.80, 46 rotatable bonds, 12 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(2-methoxyethyl)amino]pyrimidine-4-carboxamide;N-[4-(aminomethyl)phenyl]-6-[cyclopropylmethyl(propyl)amino]pyrimidine-4-carboxamide;6-[cyclopropylmethyl(2-methoxyethyl)amino]-N-(1H-indazol-5-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-4-carboxamide;6-[cyclopropylmethyl(propyl)amino]-N-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidine-4-carboxamide;N-(1H-indazol-5-yl)-6-[2-methoxyethyl(propan-2-yl)amino]pyrimidine-4-carboxamide is sourced from PubChem (CID 159136471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).